## Abstract In this theoretical work, 22 alcohols and their geometric structure properties have been investigated employing quantum chemical methods to calculate the Cο£ΏOH equilibrium bond distances and bond dissociation energies (BDEs). Since DFT methods have been researched to have low basis sets
β¦ LIBER β¦
Quantum-chemical calculations of the dissociation energy of the C-H bond in hydrocarbons, alcohols, and ethers
β Scribed by K. K. Timergazin; S. L. Khursan
- Book ID
- 112537215
- Publisher
- Springer
- Year
- 1996
- Tongue
- English
- Weight
- 470 KB
- Volume
- 45
- Category
- Article
- ISSN
- 1573-9171
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